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GLASS

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GPCR

Name	5-hydroxytryptamine receptor 1D
Species	Rattus norvegicus (Rat)
Gene	Htr1d
Synonym	5-HT1D receptor HTRL Htr1db HT1DA Gpcr14 5-HT-1D 5-HT1D 5-hydroxytryptamine (serotonin) receptor 1D, G protein-coupled 5-HT1Dalpha Serotonin receptor 1D [ Show all ]
Disease	N/A for non-human GPCRs
Length	374
Amino acid sequence	MSLPNQSLEGLPQEASNRSLNATGAWDPEVLQALRISLVVVLSIITLATVLSNAFVLTTILLTKKLHTPANYLIGSLATTDLLVSILVMPISIAYTTTRTWNFGQILCDIWVSSDITCCTASILHLCVIALDRYWAITDALEYSKRRTAGHAAAMIAAVWAISICISIPPLFWRQATAHEEMSDCLVNTSQISYTIYSTCGAFYIPSILLIILYGRIYVAARSRILNPPSLYGKRFTTAQLITGSAGSSLCSLNPSLHESHTHTVGSPLFFNQVKIKLADSILERKRISAARERKATKTLGIILGAFIICWLPFFVVSLVLPICRDSCWIHPALFDFFTWLGYLNSLINPVIYTVFNEDFRQAFQRVVHFRKAS
UniProt	P28565
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL5450
IUPHAR	3
DrugBank	N/A

Ligand

Name	Cyanopindolol
Molecular formula	C16H21N3O2
IUPAC name	4-[3-(tert-butylamino)-2-hydroxypropoxy]-1H-indole-2-carbonitrile
Molecular weight	287.363
Hydrogen bond acceptor	4
Hydrogen bond donor	3
XlogP	2.0
Synonyms	1H-Indole-2-carbonitrile, 4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)- CAS_155346 D0X8ZA PDSP1_001601 81089-45-4 CHEMBL378501 NCI60_038172 RT-012114 (+-)-Cyanopindolol BDBM81499 CYANOPINDOLOL HEMIFUMARATE NSC_155346 SR-01000597973-1 4-[3-(tert-butylamino)-2-hydroxypropoxy]-1H-indole-2-carbonitrile CHEBI:125406 GTPL132 PDSP2_001078 CTK8E9328 NSC-707473 SCHEMBL353756 (+/-)4-(3-t-butylamino-2-hydroxypropoxy)-1h-indole-2-carbonitrile BRD-A47884604-001-01-7 CYANOPINDOLOL(+/-) PDSP1_001094 69906-85-0 L000210 PDSP2_001585 (-)-Cyanopindolol AC1L4E3D NSC707473 SR-01000597973 [ Show all ]
Inchi Key	QXIUMMLTJVHILT-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H21N3O2/c1-16(2,3)18-9-12(20)10-21-15-6-4-5-14-13(15)7-11(8-17)19-14/h4-7,12,18-20H,9-10H2,1-3H3
PubChem CID	155346
ChEMBL	CHEMBL378501
IUPHAR	132
BindingDB	81499
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	36.3 nM	PMID7984267	BindingDB

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